## Is Kekulene Really Superaromatic? -A theoretical study in which a number of calculated properties of kekulene and reference compounds such as benzene, phenanthrene, and 1, 2:7,8-dibenzanthracene are compared, shows that structure (I) is the most apt description of this molecule and not a struct
✦ LIBER ✦
Is Kekulene Really Superaromatic?
✍ Scribed by Dr. Haijun Jiao; Prof. Dr. Paul von Ragué Schleyer
- Book ID
- 101557732
- Publisher
- John Wiley and Sons
- Year
- 1996
- Tongue
- English
- Weight
- 473 KB
- Volume
- 35
- Category
- Article
- ISSN
- 0044-8249
No coin nor oath required. For personal study only.
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229.41 945 -232.24870 -688,06697 [a] -696.64078 [b] -403.0 -114.7 -110.6 -80.0 -46.1 -320.8 X,,,, -769.7 -203.1 -190.5 -135.0 --69.8 -763.7 [a] Auf dem HF/3-21G-Niveau weist [18]Annulen bei D,,,-Symmetrie eine imaginire Frequenz (NIMAG = 1) auf. [b] Auf dem Becke3LYP/6-31G\*-Niveau entspricht D,,-s